SCHEMBL30139636

SCHEMBL30139636

BC(B)CCCCCCCOC(=O)/C(C)=C/C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.37
HCAR2 Q8TDS4 3/20 0.35
ZDHHC7 Q9NXF8 1/20 0.33
POLB P06746 1/20 0.32
APEX1 P27695 1/20 0.32
HTT P42858 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
LCK P06239 1/20 0.32
PPARD Q03181 1/20 0.32
ZDHHC20 Q5W0Z9 1/20 0.32
ZDHHC2 Q9UIJ5 1/20 0.32
ALDH1A1 P00352 1/20 0.31
CYP3A4 P08684 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL30139630 1.00 TSHR (0.37) TSHRHCAR2ZDHHC7POLBAPEX1
SCHEMBL30139641 1.00 TSHR (0.37) TSHRHCAR2ZDHHC7POLBAPEX1
SCHEMBL30139628 0.94 HCAR2 (0.32) TSHRHCAR2
SCHEMBL30139623 0.87 ALOX15 (0.31)
SCHEMBL29557770 0.86 KDM1A (0.42) TSHRHCAR2POLBAPEX1HTT
SCHEMBL29558194 0.86 KDM1A (0.42) TSHRHCAR2POLBAPEX1HTT
SCHEMBL30161538 0.86 KDM1A (0.42) TSHRHCAR2POLBAPEX1HTT
SCHEMBL15610425 0.80 TSHR (0.58) TSHRHCAR2ALDH1A1
SCHEMBL15610423 0.80 TSHR (0.58) TSHRHCAR2ALDH1A1
SCHEMBL5052459 0.80 TSHR (0.58) TSHRHCAR2ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11655376-B2 Surface control agent for water-based coating, water-based coating composition, coating film, and multilayer coating film KUSUMOTO CHEMICALS, LTD. (JP) 2023-05-23 US disclosed
EP-3808827-B1 SURFACE CONDITIONER FOR AQUEOUS COATING MATERIAL, AQUEOUS COATING COMPOSITION, COATING FILM, AND MULTILAYER COATING FILM KUSUMOTO CHEMICALS (JP) 2023-01-18 EP disclosed